xdatbus.c02b_xyz_unwarp ======================= .. py:module:: xdatbus.c02b_xyz_unwarp Functions --------- .. autoapisummary:: xdatbus.c02b_xyz_unwarp.xyz_unwrap Module Contents --------------- .. py:function:: xyz_unwrap(xyz_path, lattice) Unwrap the coordinates in the xyz file. The unwrapped coordinates will be written to a new xyz file. Parameters ---------- xyz_path : str Input path of the xyz file lattice : list Lattice vectors of the system